8',11'-bis(3-phenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole]

C55H35N — CID 118331815

IUPAC8',11'-bis(3-phenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole]
SMILESc1ccc(-c2cccc(-c3ccc4c(c3)c3ccc5c(c3n4-c3cccc(-c4ccccc4)c3)C3(c4ccccc4-c4ccccc43)c3ccccc3-5)c2)cc1
InChIInChI=1S/C55H35N/c1-3-15-36(16-4-1)38-19-13-20-39(33-38)41-29-32-52-48(35-41)47-31-30-46-45-25-9-12-28-51(45)55(49-26-10-7-23-43(49)44-24-8-11-27-50(44)55)53(46)54(47)56(52)42-22-14-21-40(34-42)37-17-5-2-6-18-37/h1-35H
InChIKeyKYEZWFDWTYWEBO-UHFFFAOYSA-N
MW709.89 g/mol
LogP14.13
Rot. Bonds4

About 8',11'-bis(3-phenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole]

8',11'-bis(3-phenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole] (PubChem CID 118331815) has the molecular formula C55H35N and a molecular weight of 709.89 g/mol. Its IUPAC name is 8',11'-bis(3-phenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole].

Molecular Properties

Compound Name8',11'-bis(3-phenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole]
PubChem CID118331815
Molecular FormulaC55H35N
Molecular Weight709.89 g/mol
Exact Mass709.28
IUPAC Name8',11'-bis(3-phenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole]
SMILESc1ccc(-c2cccc(-c3ccc4c(c3)c3ccc5c(c3n4-c3cccc(-c4ccccc4)c3)C3(c4ccccc4-c4ccccc43)c3ccccc3-5)c2)cc1
InChIInChI=1S/C55H35N/c1-3-15-36(16-4-1)38-19-13-20-39(33-38)41-29-32-52-48(35-41)47-31-30-46-45-25-9-12-28-51(45)55(49-26-10-7-23-43(49)44-24-8-11-27-50(44)55)53(46)54(47)56(52)42-22-14-21-40(34-42)37-17-5-2-6-18-37/h1-35H
InChIKeyKYEZWFDWTYWEBO-UHFFFAOYSA-N
XLogP14.13
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500709.89
LogP ≤ 514.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

11'-[4-(9-phenylcarbazol-4-yl)phenyl]-8'-(3-phenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole]
CID 118332070
11'-(3,5-diphenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole]
CID 118331859
2',8,11-triphenylspiro[indeno[2,1-a]carbazole-12,9'-xanthene]
CID 129133135
12,12-dimethyl-8,11-diphenylindeno[2,1-a]carbazole
CID 121287062
7,7-diphenyl-12-(3-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]indeno[1,2-a]carbazole
CID 121343577
12,12-dimethyl-11-naphthalen-1-yl-8-[9-(3-phenylphenyl)carbazol-3-yl]indeno[2,1-a]carbazole
CID 121344070
3-[9-[4-[3-[4-[3-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 154590573
12'-phenyl-3'-(12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole]-3'-yl)spiro[fluorene-9,7'-indeno[1,2-a]carbazole]
CID 90253707
3-(9-phenylcarbazol-1-yl)-6-(9-phenylfluoren-9-yl)-9-(3-phenylphenyl)carbazole
CID 121311539
11-(4,6-diphenyl-1,3,5-triazin-2-yl)-12,12-diphenylindeno[2,1-a]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12,12-diphenylindeno[2,1-a]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,12,12-triphenylindeno[2,1-a]carbazole;11-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,12,12-triphenylindeno[2,1-a]carbazole
CID 158116203
11-(4,6-diphenyl-1,3,5-triazin-2-yl)-12,12-diphenylindeno[2,1-a]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,12,12-triphenylindeno[2,1-a]carbazole;11-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,12,12-triphenylindeno[2,1-a]carbazole
CID 161266285
3-[4-[9-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-9-yl]phenyl]-9-[3-[9-[4-[4-[9-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-9-yl]phenyl]phenyl]carbazol-3-yl]phenyl]carbazole
CID 146517009

Frequently Asked Questions

What is the IUPAC name of 8',11'-bis(3-phenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole]?
The IUPAC name of 8',11'-bis(3-phenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole] (CID 118331815) is 8',11'-bis(3-phenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole].
What is the SMILES notation for 8',11'-bis(3-phenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole]?
The canonical SMILES for 8',11'-bis(3-phenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole] is c1ccc(-c2cccc(-c3ccc4c(c3)c3ccc5c(c3n4-c3cccc(-c4ccccc4)c3)C3(c4ccccc4-c4ccccc43)c3ccccc3-5)c2)cc1.
What is the InChIKey of 8',11'-bis(3-phenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole]?
The InChIKey is KYEZWFDWTYWEBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H35N/c1-3-15-36(16-4-1)38-19-13-20-39(33-38)41-29-32-52-48(35-41)47-31-30-46-45-25-9-12-28-51(45)55(49-26-10-7-23-43(49)44-24-8-11-27-50(44)55)53(46)54(47)56(52)42-22-14-21-40(34-42)37-17-5-2-6-18-37/h1-35H.
What are the key properties of 8',11'-bis(3-phenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole]?
8',11'-bis(3-phenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole] has a molecular weight of 709.89 g/mol, XLogP of 14.13, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8',11'-bis(3-phenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole] is sourced from PubChem (CID 118331815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).